%chk=000036827.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036827

0 1
 S    1.643100       1.753500     -4.3900002E-02
 S    1.644400      -1.752600      3.9600000E-02
 O   -3.177200     -5.0000002E-04  1.3900000E-02
 O   -1.438700       2.297000     -1.2500000E-02
 O   -1.437200      -2.294900      0.1146000    
 N   -1.800600     -2.4000001E-03 -7.0600003E-02
 C   0.3346000      0.6675000     -2.7899999E-02
 C   0.3350000     -0.6683000     -3.1999999E-03
 C    3.013000      0.6459000      0.4151000    
 C    3.020600     -0.6438000     -0.3972000    
 C   -1.068900       1.137000     -4.4500001E-02
 C   -1.068200      -1.138400      1.6500000E-02
 H    2.971200      0.4409000       1.491000    
 H    3.943300       1.193300      0.2299000    
 H    2.996400     -0.4389000      -1.473600    
 H    3.948300      -1.190000     -0.1964000    
 H   -3.419200     -2.5800001E-02 -0.9274000    


%chk=000036827-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000036827

0 1
S 1.701272 1.855826 0.020562
S 1.706498 -1.851291 0.063600
O -3.248992 0.011399 0.100277
O -1.491524 2.360198 -0.125119
O -1.499631 -2.360376 0.039488
N -1.862114 -0.006390 -0.233182
C 0.343695 0.685949 -0.017543
C 0.341800 -0.688494 0.027678
C 3.104136 0.646180 0.447872
C 3.100944 -0.641556 -0.387582
C -1.068888 1.185550 -0.119829
C -1.072441 -1.189688 -0.032589
H 3.048646 0.429269 1.525677
H 4.017224 1.230348 0.241926
H 3.031146 -0.426561 -1.465150
H 4.018602 -1.221787 -0.192055
H -3.730472 -0.039075 -0.770630


